(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine

C10H15N3O2S — CID 83851068

IUPAC(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine
SMILESNCc1nc2c(n1C1CC1)CCS(=O)(=O)C2
InChIInChI=1S/C10H15N3O2S/c11-5-10-12-8-6-16(14,15)4-3-9(8)13(10)7-1-2-7/h7H,1-6,11H2
InChIKeyQZSXWRNTAGIBRZ-UHFFFAOYSA-N
MW241.32 g/mol
LogP0.15
Rot. Bonds2

About (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine

(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine (PubChem CID 83851068) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine.

Molecular Properties

Compound Name(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine
PubChem CID83851068
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine
SMILESNCc1nc2c(n1C1CC1)CCS(=O)(=O)C2
InChIInChI=1S/C10H15N3O2S/c11-5-10-12-8-6-16(14,15)4-3-9(8)13(10)7-1-2-7/h7H,1-6,11H2
InChIKeyQZSXWRNTAGIBRZ-UHFFFAOYSA-N
XLogP0.15
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-methyl-7,7-dioxo-6,8-dihydro-5H-thiopyrano[3,4-d]pyrimidin-4-yl)methanamine
CID 82391352
2-ethyl-1-(4-methylcyclohexyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856928
1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[4,3-c]pyrazole-3-carbonitrile
CID 105499027
2-(2-aminoethyl)-7,7-dioxo-3,5,6,8-tetrahydrothiopyrano[3,4-d]pyrimidin-4-one
CID 136918043
4-(2-tert-butyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl)thiane 1,1-dioxide
CID 64856948
2-methyl-6,6-dioxo-5,7-dihydro-4H-thiopyrano[3,4-c]pyrazol-3-amine
CID 105453536
(5-cycloheptyl-4-cyclopropyl-1,2,4-triazol-3-yl)methanamine
CID 112593244
2-[1-(1,1-dioxothiolan-3-yl)benzimidazol-2-yl]ethanamine
CID 63636344
[4-cyclopropyl-5-(3,3,3-trifluoropropyl)-1,2,4-triazol-3-yl]methanamine
CID 112593153
[4-cyclopropyl-5-(2-methylbutyl)-1,2,4-triazol-3-yl]methanamine
CID 114877746
2-cyclopropyl-6,7-dihydro-4H-thiopyrano[4,3-d][1,3]thiazole 5,5-dioxide
CID 130511969
5-[[5-(aminomethyl)-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]pyrrolidin-2-one
CID 107530249

Frequently Asked Questions

What is the IUPAC name of (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine?
The IUPAC name of (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine (CID 83851068) is (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine.
What is the SMILES notation for (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine?
The canonical SMILES for (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine is NCc1nc2c(n1C1CC1)CCS(=O)(=O)C2.
What is the InChIKey of (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine?
The InChIKey is QZSXWRNTAGIBRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2S/c11-5-10-12-8-6-16(14,15)4-3-9(8)13(10)7-1-2-7/h7H,1-6,11H2.
What are the key properties of (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine?
(1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine has a molecular weight of 241.32 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopropyl-5,5-dioxo-6,7-dihydro-4H-thiopyrano[3,4-d]imidazol-2-yl)methanamine is sourced from PubChem (CID 83851068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).